2-[[4-(2-ethylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole

Systemtic Name: 2-[[4-(2-ethylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Openeye Name: 2-[[4-(2-ethylphenyl)-5-morpholino-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole CAS Name: 2-[[[4-(2-ethylphenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole IUPAC Name: 2-[[4-(2-ethylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Traditional Name: 2-[[[4-(2-ethylphenyl)-5-morpholino-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=NN=C2SCC3=NC4=CC=CC=C4O3)N5CCOCC5

Isomeric SMILES

CCC1=CC=CC=C1N2C(=NN=C2SCC3=NC4=CC=CC=C4O3)N5CCOCC5

InChI

InChI=1S/C22H23N5O2S/c1-2-16-7-3-5-9-18(16)27-21(26-11-13-28-14-12-26)24-25-22(27)30-15-20-23-17-8-4-6-10-19(17)29-20/h3-10H,2,11-15H2,1H3